5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole

Base Information

• Chemical Name: 5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole
• CAS No.: 124750-53-4
• Molecular Formula: C33H26N4
• Molecular Weight: 478.596
• DSSTox Substance ID: DTXSID20436185
• Nikkaji Number: J3.581.810C
• Wikidata: Q72488259
• Mol file: 124750-53-4.mol

Synonyms:124750-53-4;5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole;5-(4'-METHYLBIPHENYL-2-YL)-1-TRITYL-1H-TETRAZOLE;5-[2-(4-methylphenyl)phenyl]-1-trityltetrazole;N-(Triphenylmethyl)-5-(4'-Methylbiphenyl-2-yl) Tetrazole;Tetrazole, 5-(4'-methyl[1,1'-biphenyl]-2-yl)(triphenylmethyl)-;1H-Tetrazole, 5-(4'-methyl[1,1'-biphenyl]-2-yl)-1-(triphenylmethyl)-;Losartan Impurity 5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole;C33H26N4;5-[4'-Methyl (1,1'-biphenyl)-2-yl]-1-triphenylmethyl-tetrazole;SCHEMBL635;5-(4-Methylbiphenyl-2-yl)-1-trityl-1H-tetrazole;DTXSID20436185;N-(Triphenylmethyl)-5-(4'-methylbiphenyl-2-yl-)tetrazole;ZSBYTGRKIKIRRJ-UHFFFAOYSA-N;BCP25559;MFCD00665220;AKOS000278515;CS-0153067;FT-0656612;J3.581.810C;O11294;A805289;1-Trityl-5-(4'-methylbiphenyl-2-yl)-1H-tetrazole;2-(Triphenylmethyltetrazol-5-yl)-4'-methylbiphenyl;4-Methyl-2'-(triphenylmethyltetrazol-5-yl)biphenyl;J-516266;5-(4/'-Methylbiphenyl-2-YL)-1-trityl-1H-tetrazole;N-(Triphenylmethyl)-5-(4'-methylbiphenyl-2-yl-) Tetrazole;4-Methyl-2'-(N-triphenylmethyl-(1H-tetrazol-5-yl))biphenyl;N-TRIPHENYLMETHYL-5-(4'-METHYLBIPHENYL-2-YL) TETRAZOLE;N-(Triphenylmethyl)-5-(4'-methylbiphenyl-2-yl-)tetrazole (TTMB);5-(4'-Methyl[1,1'-biphenyl]-2-yl)-1-(triphenylmethyl)-1H-tetrazole;N-(?????)-5-(4,-????-2-?) ?;1-(2-benzhydrylphenyl)-5-[2-(p-tolyl)phenyl]tetrazole

Chemical Property of 5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole

Chemical Property:

• Melting Point: 166-169 °C(Solv: ethyl acetate (141-78-6); dichloromethane (75-09-2))
• Boiling Point: 681.633 °C at 760 mmHg
• PKA: 0.30±0.10(Predicted)
• Flash Point: 366.038 °C
• PSA: 43.60000
• Density: 1.136 g/cm³
• LogP: 7.15570
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: Chloroform (Slightly)
• XLogP3: 8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 478.21574685
• Heavy Atom Count: 37
• Complexity: 639

Purity/Quality:

99% ^*data from raw suppliers

N-Triphenylmethyl-5-[4''-methylbiphenyl-2-yl]tetrazole-d4 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=CC=CC=C2C3=NN=NN3C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6
• Uses: An intermediate in the preparation of labelled Candesartan. 5-?(4''-?Methyl-?[1,?1''-?biphenyl]?-?2-?yl)?-?1-?trityl-?1H-?tetrazole is a reactant in the synthesis of anti-microbial agents.

Technology Process of 5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole

There total 24 articles about 5-(4'-Methyl-[1,1'-biphenyl]-2-yl)-1-trityl-1H-tetrazole which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

trityl chloride (76-83-5) + 2-(tetrazol-5-yl)-4'-methyl-1,1'-biphenyl (120568-11-8) → N-triphenylmethyl-5-(4'-methylbiphenyl-2-yl)tetrazole (124750-53-4)

Guidance literature:

With triethylamine; In dichloromethane; at 0 ℃; for 2h; Reflux;

Reference yield: 85.0%

2-Cyano-4'-methylbiphenyl (114772-53-1) + trityl chloride (76-83-5) → N-triphenylmethyl-5-(4'-methylbiphenyl-2-yl)tetrazole (124750-53-4)

Guidance literature:

2-Cyano-4'-methylbiphenyl; With sodium azide; tributyltin chloride; In toluene; Reflux;

trityl chloride; With sodium hydroxide; In water; toluene;

DOI:10.1016/j.bmc.2013.01.067

Reference yield: 73.0%

N-(triphenylmethyl)phenyltetrazole (154750-11-5) + 4,4'-dimethyldiphenyliodonium fluoroborate → N-triphenylmethyl-5-(4'-methylbiphenyl-2-yl)tetrazole (124750-53-4)

Guidance literature:

With palladium on activated charcoal; sodium hydroxide; In 1,2-dichloro-ethane; at 80 ℃; for 6h;

upstream raw materials:

2-Cyano-4'-methylbiphenyl

trityl chloride

salicylonitrile

4-tolyl iodide

Downstream raw materials:

2-Butyl-4-chloro-1-[[2'-[1-(triphenylmethyl)-1H-tetrazol-5-yl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-methanol

C₂₉H₂₂N₆S₂

C₂₉H₂₁FN₆S₂

C₂₉H₂₁N₇O₂S₂

Refernces

• 1、 -. "Method for synthesizing high-purity sartan side chain TTBB". Paragraph 0020; 0040-0042. . Retrieved 2018/06/15.
• 2、 -. "1,(3,)5-substituted imidazoles, useful in the treatment of hypertension and methods for their preparation". . . Retrieved 2016/03/04.